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Concept information

Preferred term

diadenosine diphosphate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C20H26N10O13P2

inchi

  • InChI=1S/C20H26N10O13P2/c21-15-9-17(25-3-23-15)29(5-27-9)19-12(33)11(32)8(41-19)2-39-44(35,36)43-45(37,38)42-14-7(1-31)40-20(13(14)34)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-34H,1-2H2,(H,35,36)(H,37,38)(H2,21,23,25)(H2,22,24,26)/t7-,8-,11-,12-,13-,14-,19-,20+/m1/s1

inchikey

  • FHISWBUCBBVWGG-SNESVTBZSA-N

mass

  • 676.433

monoisotopicmass

  • 676.11560

smiles

  • P(O[C@H]1[C@@H](O)[C@H](O[C@@H]1CO)N2C3=NC=NC(N)=C3N=C2)(OP(OC[C@H]4O[C@@H](N5C6=NC=NC(N)=C6N=C5)[C@H](O)[C@@H]4O)(O)=O)(O)=O

subset

  • 2_STAR

synonym EXACT

  • [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5S)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168561

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